1-[4-[[6-(2-bromanyl-4-methoxy-phenoxy)pyrimidin-4-yl]amino]phenoxy]-3-(dimethylamino)propan-2-ol

Systemtic Name: 1-[4-[[6-(2-bromanyl-4-methoxy-phenoxy)pyrimidin-4-yl]amino]phenoxy]-3-(dimethylamino)propan-2-ol Openeye Name: 1-[4-[[6-(2-bromo-4-methoxy-phenoxy)pyrimidin-4-yl]amino]phenoxy]-3-(dimethylamino)propan-2-ol CAS Name: 1-[4-[[6-(2-bromo-4-methoxyphenoxy)-4-pyrimidinyl]amino]phenoxy]-3-(dimethylamino)-2-propanol IUPAC Name: 1-[4-[[6-(2-bromo-4-methoxyphenoxy)pyrimidin-4-yl]amino]phenoxy]-3-(dimethylamino)propan-2-ol Traditional Name: 1-[4-[[6-(2-bromo-4-methoxy-phenoxy)pyrimidin-4-yl]amino]phenoxy]-3-(dimethylamino)propan-2-ol Formula: C22H25BrN4O4 MolecularWeight: 489.3623

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Descriptors Computed from Structure

Canonical SMILES:

CN(C)CC(COC1=CC=C(C=C1)NC2=CC(=NC=N2)OC3=C(C=C(C=C3)OC)Br)O

Isomeric SMILES

CN(C)CC(COC1=CC=C(C=C1)NC2=CC(=NC=N2)OC3=C(C=C(C=C3)OC)Br)O

InChI

InChI=1S/C22H25BrN4O4/c1-27(2)12-16(28)13-30-17-6-4-15(5-7-17)26-21-11-22(25-14-24-21)31-20-9-8-18(29-3)10-19(20)23/h4-11,14,16,28H,12-13H2,1-3H3,(H,24,25,26)